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tert-Butyl 1,2,3,4,5,6-hexahydro-1,6-benzodiazocine-1-carboxylate

  • CAS No. 946386-51-2

  • Cat. No. CS-0127327
  • Purity≥98%
  • MDL No.MFCD09832500

*For research and further manufacturing use only, not for direct human use.

tert-Butyl 1,2,3,4,5,6-hexahydro-1,6-benzodiazocine-1-carboxylate|CS-0127327

Structure of 946386-51-2

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General Information

  • CAS No. 946386-51-2
  • Cat. No. CS-0127327
  • Purity ≥98%
  • MDL No. MFCD09832500
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₂₂N₂O₂
  • Molecular Weight 262.35
  • Synonym(s) 1,6-Benzodiazocine-1(2H)-carboxylic acid, 3,4,5,6-tetrahydro-, 1,1-dimethylethyl ester
  • SMILES O=C(N1CCCCNC2=CC=CC=C21)OC(C)(C)C

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   41.57
  • LogP   3.6338
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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